BO7A2R -OEChem-04022106573D 40 42 0 0 0 0 0 0 0999 V2000 1.8479 1.7198 0.1019 S 0 0 0 0 0 0 0 0 0 0 0 0 0.7871 -2.5858 0.4452 O 0 0 0 0 0 0 0 0 0 0 0 0 2.6731 -3.0744 -0.7256 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9140 2.2201 0.1475 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.4546 -0.7161 0.0816 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.1358 0.0001 -0.0050 N 0 0 0 0 0 0 0 0 0 0 0 0 6.0069 -0.0534 0.3371 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8385 -0.9468 -0.1081 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9153 1.3487 -0.2829 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5286 -0.2249 -0.0354 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6274 2.0751 0.1370 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4522 1.1522 0.0532 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2300 -0.8160 -0.0722 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2273 0.1272 -0.0039 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9562 -2.2285 -0.1645 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1232 1.0145 0.0680 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5371 0.5555 0.0728 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5120 1.4010 -0.4132 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8279 -0.7007 0.5622 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8389 0.9707 -0.4097 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1548 -1.1311 0.5656 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1603 -0.2954 0.0797 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.4320 0.1879 -0.4314 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0040 0.0379 1.4310 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9553 -0.5257 0.0574 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8198 -1.8457 0.5183 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0038 -1.2687 -1.1437 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9458 1.2585 -1.3764 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7846 1.9469 0.0127 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4834 2.9565 -0.4981 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7303 2.4248 1.1717 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4506 -0.9599 -0.1094 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6181 -3.5493 0.3713 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2773 2.3870 -0.8033 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0821 -1.3663 0.9832 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5695 1.6694 -0.8029 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4005 -2.1153 0.9552 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.4909 1.1010 0.1706 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.4044 -0.3093 -0.3537 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2656 0.4006 -1.4929 H 0 0 0 0 0 0 0 0 0 0 0 0 1 12 1 0 0 0 0 1 14 1 0 0 0 0 2 15 1 0 0 0 0 2 33 1 0 0 0 0 3 15 2 0 0 0 0 4 16 2 0 0 0 0 5 22 1 0 0 0 0 5 23 1 0 0 0 0 6 14 1 0 0 0 0 6 16 1 0 0 0 0 6 32 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 24 1 0 0 0 0 7 25 1 0 0 0 0 8 10 1 0 0 0 0 8 26 1 0 0 0 0 8 27 1 0 0 0 0 9 11 1 0 0 0 0 9 28 1 0 0 0 0 9 29 1 0 0 0 0 10 12 2 0 0 0 0 10 13 1 0 0 0 0 11 12 1 0 0 0 0 11 30 1 0 0 0 0 11 31 1 0 0 0 0 13 14 2 0 0 0 0 13 15 1 0 0 0 0 16 17 1 0 0 0 0 17 18 2 0 0 0 0 17 19 1 0 0 0 0 18 20 1 0 0 0 0 18 34 1 0 0 0 0 19 21 2 0 0 0 0 19 35 1 0 0 0 0 20 22 2 0 0 0 0 20 36 1 0 0 0 0 21 22 1 0 0 0 0 21 37 1 0 0 0 0 23 38 1 0 0 0 0 23 39 1 0 0 0 0 23 40 1 0 0 0 0 M END $$$$